N-[(1S)-1-naphthalen-1-ylethyl]pyridine-2-sulfonamide

C17H16N2O2S — CID 11289932

IUPACN-[(1S)-1-naphthalen-1-ylethyl]pyridine-2-sulfonamide
SMILESC[C@H](NS(=O)(=O)c1ccccn1)c1cccc2ccccc12
InChIInChI=1S/C17H16N2O2S/c1-13(19-22(20,21)17-11-4-5-12-18-17)15-10-6-8-14-7-2-3-9-16(14)15/h2-13,19H,1H3/t13-/m0/s1
InChIKeyXWJDCJUZKOMKET-ZDUSSCGKSA-N
MW312.39 g/mol
LogP3.27
Rot. Bonds4

About N-[(1S)-1-naphthalen-1-ylethyl]pyridine-2-sulfonamide

N-[(1S)-1-naphthalen-1-ylethyl]pyridine-2-sulfonamide (PubChem CID 11289932) has the molecular formula C17H16N2O2S and a molecular weight of 312.39 g/mol. Its IUPAC name is N-[(1S)-1-naphthalen-1-ylethyl]pyridine-2-sulfonamide.

Molecular Properties

Compound NameN-[(1S)-1-naphthalen-1-ylethyl]pyridine-2-sulfonamide
PubChem CID11289932
Molecular FormulaC17H16N2O2S
Molecular Weight312.39 g/mol
Exact Mass312.09
IUPAC NameN-[(1S)-1-naphthalen-1-ylethyl]pyridine-2-sulfonamide
SMILESC[C@H](NS(=O)(=O)c1ccccn1)c1cccc2ccccc12
InChIInChI=1S/C17H16N2O2S/c1-13(19-22(20,21)17-11-4-5-12-18-17)15-10-6-8-14-7-2-3-9-16(14)15/h2-13,19H,1H3/t13-/m0/s1
InChIKeyXWJDCJUZKOMKET-ZDUSSCGKSA-N
XLogP3.27
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.39
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-1-naphthalen-1-yl-N-[(1S)-1-pyridin-2-ylethyl]ethanamine
CID 10754955
N-[(1S)-1-(4-methylphenyl)ethyl]pyridine-2-sulfonamide
CID 101377414
1-[(1S)-1-(dimethylsulfamoylamino)ethyl]naphthalene
CID 35308399
1-[1-(dimethylsulfamoylamino)ethyl]naphthalene
CID 42955136
N-(1-naphthalen-1-ylethyl)-4-nitrobenzenesulfonamide
CID 55353964
(2S)-2-(pyridin-2-ylsulfonylamino)propanoic acid
CID 122069786
N-(1-naphthalen-1-ylethyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
CID 46799948
N-[2-(1-naphthalen-1-ylethylamino)ethyl]methanesulfonamide
CID 43208119
4-(4-methylpiperazin-1-yl)-N-(1-naphthalen-1-ylethyl)thieno[3,2-c]pyridine-2-sulfonamide;hydrochloride
CID 67156592
5-(aminomethyl)-N-(1-pyridin-2-ylethyl)pyridine-2-sulfonamide
CID 106022983
1-[(1S)-1-naphthalen-1-ylethyl]-3-pyridin-2-ylthiourea
CID 3003559
lithium bis[[(1S)-1-naphthalen-1-ylethyl]amino]azanide
CID 177413049

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-naphthalen-1-ylethyl]pyridine-2-sulfonamide?
The IUPAC name of N-[(1S)-1-naphthalen-1-ylethyl]pyridine-2-sulfonamide (CID 11289932) is N-[(1S)-1-naphthalen-1-ylethyl]pyridine-2-sulfonamide.
What is the SMILES notation for N-[(1S)-1-naphthalen-1-ylethyl]pyridine-2-sulfonamide?
The canonical SMILES for N-[(1S)-1-naphthalen-1-ylethyl]pyridine-2-sulfonamide is C[C@H](NS(=O)(=O)c1ccccn1)c1cccc2ccccc12.
What is the InChIKey of N-[(1S)-1-naphthalen-1-ylethyl]pyridine-2-sulfonamide?
The InChIKey is XWJDCJUZKOMKET-ZDUSSCGKSA-N. The full InChI is InChI=1S/C17H16N2O2S/c1-13(19-22(20,21)17-11-4-5-12-18-17)15-10-6-8-14-7-2-3-9-16(14)15/h2-13,19H,1H3/t13-/m0/s1.
What are the key properties of N-[(1S)-1-naphthalen-1-ylethyl]pyridine-2-sulfonamide?
N-[(1S)-1-naphthalen-1-ylethyl]pyridine-2-sulfonamide has a molecular weight of 312.39 g/mol, XLogP of 3.27, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-naphthalen-1-ylethyl]pyridine-2-sulfonamide is sourced from PubChem (CID 11289932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).